REMARK  Name = BDB018784
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.423   2.225   0.076  0.00  0.00    -0.265 N 
ATOM      2  C   LIG    1       -3.391   0.831   0.630  0.00  0.00    +0.174 C 
ATOM      3  C   LIG    1       -3.258  -0.108  -0.588  0.00  0.00    +0.205 C 
ATOM      4  C   LIG    1       -4.010  -1.417  -0.286  0.00  0.00    +0.263 C 
ATOM      5  O   LIG    1       -5.214  -1.583  -0.452  0.00  0.00    -0.271 OA
ATOM      6  N   LIG    1       -3.241  -2.392   0.295  0.00  0.00    -0.278 N 
ATOM      7  H   LIG    1       -3.710  -3.238   0.595  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1       -1.851  -2.277   0.344  0.00  0.00    +0.096 A 
ATOM      9  C   LIG    1       -1.201  -1.205  -0.268  0.00  0.00    +0.238 A 
ATOM     10  N   LIG    1        0.134  -1.048  -0.278  0.00  0.00    -0.207 NA
ATOM     11  C   LIG    1        0.870  -1.993   0.360  0.00  0.00    +0.129 A 
ATOM     12  C   LIG    1        0.301  -3.106   0.981  0.00  0.00    +0.035 A 
ATOM     13  C   LIG    1       -1.085  -3.250   0.972  0.00  0.00    +0.031 A 
ATOM     14  O   LIG    1       -1.883  -0.236  -0.957  0.00  0.00    -0.457 OA
ATOM     15  C   LIG    1       -3.953   0.704  -1.681  0.00  0.00    +0.079 C 
ATOM     16  C   LIG    1       -3.485   2.126  -1.406  0.00  0.00    +0.121 C 
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1        2.368  -1.869   0.342  0.00  0.00    +0.265 C 
ATOM     18  N   LIG    1        2.985  -0.624   0.169  0.00  0.00    -0.296 N 
ATOM     19  C   LIG    1        2.294   0.667   0.261  0.00  0.00    +0.108 C 
ATOM     20  C   LIG    1        3.234   1.796   0.672  0.00  0.00    +0.019 C 
ATOM     21  C   LIG    1        4.426   1.928  -0.273  0.00  0.00    +0.003 C 
ATOM     22  C   LIG    1        4.867   0.590  -0.867  0.00  0.00    +0.019 C 
ATOM     23  C   LIG    1        4.435  -0.593  -0.010  0.00  0.00    +0.108 C 
ATOM     24  O   LIG    1        3.024  -2.904   0.487  0.00  0.00    -0.268 OA
ENDBRANCH  11  17
BRANCH   1  26
ATOM     25  N   LIG    1       -2.535   4.210   1.301  0.00  0.00    -0.174 NA
ATOM     26  C   LIG    1       -2.953   3.294   0.730  0.00  0.00    +0.169 C 
ENDBRANCH   1  26
TORSDOF 2